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Concept information

Preferred term

a83016f  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C37H55NO10

inchi

  • InChI=1S/C37H55NO10/c1-8-10-13-20-30-36(5,6)33(42)34(43)37(45,48-30)26(9-2)35(44)38-22-17-16-18-24(3)32(46-7)25(4)29-23-27(39)28(47-29)19-14-11-12-15-21-31(40)41/h8,10-21,25-30,32-34,39,42-43,45H,9,22-23H2,1-7H3,(H,38,44)(H,40,41)

inchikey

  • NVGDRZNFKVTHMG-UHFFFAOYSA-N

mass

  • 673.844

monoisotopicmass

  • 673.38260

smiles

  • O=C(O)C=CC=CC=CC1OC(C(C(OC)C(=CC=CCNC(=O)C(C2(OC(C=CC=CC)C(C)(C)C(C2O)O)O)CC)C)C)CC1O

subset

  • 2_STAR

synonym EXACT

  • (2E,4E,6E)-7-[(2R,3R,5R)-3-hydroxy-5-[(2S,3S,4E,6E)-3-methoxy-4-methyl-8-[[(2S)-2-[(2R,3R,4R,6S)-2,3,4-trihydroxy-5,5-dimethyl-6-[(1E,3Z)-penta-1,3-dienyl]oxan-2-yl]butanoyl]amino]octa-4,6-dien-2-yl]oxolan-2-yl]hepta-2,4,6-trienoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201501

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